3-acetamido-N-[3-[bis(2-methylpropyl)amino]propyl]-4-(4-fluorophenyl)sulfanyl-benzamide

Systemtic Name: 3-acetamido-N-[3-[bis(2-methylpropyl)amino]propyl]-4-(4-fluorophenyl)sulfanyl-benzamide Openeye Name: 3-acetamido-N-[3-(diisobutylamino)propyl]-4-(4-fluorophenyl)sulfanyl-benzamide CAS Name: 3-acetamido-N-[3-[bis(2-methylpropyl)amino]propyl]-4-[(4-fluorophenyl)thio]benzamide IUPAC Name: 3-acetamido-N-[3-[bis(2-methylpropyl)amino]propyl]-4-(4-fluorophenyl)sulfanylbenzamide Traditional Name: 3-acetamido-N-[3-(diisobutylamino)propyl]-4-[(4-fluorophenyl)thio]benzamide Formula: C26H36FN3O2S MolecularWeight: 473.646343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CCCNC(=O)C1=CC(=C(C=C1)SC2=CC=C(C=C2)F)NC(=O)C)CC(C)C

Isomeric SMILES

CC(C)CN(CCCNC(=O)C1=CC(=C(C=C1)SC2=CC=C(C=C2)F)NC(=O)C)CC(C)C

InChI

InChI=1S/C26H36FN3O2S/c1-18(2)16-30(17-19(3)4)14-6-13-28-26(32)21-7-12-25(24(15-21)29-20(5)31)33-23-10-8-22(27)9-11-23/h7-12,15,18-19H,6,13-14,16-17H2,1-5H3,(H,28,32)(H,29,31)